(6,7-dimethyl-1,2,3,4-tetrahydroacridin-9-yl)methanol

C16H19NO — CID 82450980

IUPAC(6,7-dimethyl-1,2,3,4-tetrahydroacridin-9-yl)methanol
SMILESCc1cc2nc3c(c(CO)c2cc1C)CCCC3
InChIInChI=1S/C16H19NO/c1-10-7-13-14(9-18)12-5-3-4-6-15(12)17-16(13)8-11(10)2/h7-8,18H,3-6,9H2,1-2H3
InChIKeyLYBPDGIJLIRHOV-UHFFFAOYSA-N
MW241.33 g/mol
LogP3.22
Rot. Bonds1

About (6,7-dimethyl-1,2,3,4-tetrahydroacridin-9-yl)methanol

(6,7-dimethyl-1,2,3,4-tetrahydroacridin-9-yl)methanol (PubChem CID 82450980) has the molecular formula C16H19NO and a molecular weight of 241.33 g/mol. Its IUPAC name is (6,7-dimethyl-1,2,3,4-tetrahydroacridin-9-yl)methanol.

Molecular Properties

Compound Name(6,7-dimethyl-1,2,3,4-tetrahydroacridin-9-yl)methanol
PubChem CID82450980
Molecular FormulaC16H19NO
Molecular Weight241.33 g/mol
Exact Mass241.15
IUPAC Name(6,7-dimethyl-1,2,3,4-tetrahydroacridin-9-yl)methanol
SMILESCc1cc2nc3c(c(CO)c2cc1C)CCCC3
InChIInChI=1S/C16H19NO/c1-10-7-13-14(9-18)12-5-3-4-6-15(12)17-16(13)8-11(10)2/h7-8,18H,3-6,9H2,1-2H3
InChIKeyLYBPDGIJLIRHOV-UHFFFAOYSA-N
XLogP3.22
TPSA33.12 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms18
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.33
LogP ≤ 53.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (6,7-dimethyl-1,2,3,4-tetrahydroacridin-9-yl)methanol?
The IUPAC name of (6,7-dimethyl-1,2,3,4-tetrahydroacridin-9-yl)methanol (CID 82450980) is (6,7-dimethyl-1,2,3,4-tetrahydroacridin-9-yl)methanol.
What is the SMILES notation for (6,7-dimethyl-1,2,3,4-tetrahydroacridin-9-yl)methanol?
The canonical SMILES for (6,7-dimethyl-1,2,3,4-tetrahydroacridin-9-yl)methanol is Cc1cc2nc3c(c(CO)c2cc1C)CCCC3.
What is the InChIKey of (6,7-dimethyl-1,2,3,4-tetrahydroacridin-9-yl)methanol?
The InChIKey is LYBPDGIJLIRHOV-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H19NO/c1-10-7-13-14(9-18)12-5-3-4-6-15(12)17-16(13)8-11(10)2/h7-8,18H,3-6,9H2,1-2H3.
What are the key properties of (6,7-dimethyl-1,2,3,4-tetrahydroacridin-9-yl)methanol?
(6,7-dimethyl-1,2,3,4-tetrahydroacridin-9-yl)methanol has a molecular weight of 241.33 g/mol, XLogP of 3.22, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (6,7-dimethyl-1,2,3,4-tetrahydroacridin-9-yl)methanol is sourced from PubChem (CID 82450980), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).